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Schwaller, P., Petraglia, R., Zullo, V., Nair, V. H., Haeuselmann, R. A., Pisoni, R., Bekas, C., Iuliano, A., & Laino, T. (2020). Predicting retrosynthetic pathways using transformer-based models and a hyper-graph exploration strategy. Chemical Science, 11(12), 3316–3325. https://doi.org/10.1039/c9sc05704h

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